![(3S,4aR)-3-iso-Butyl-8-hydroxy-3,4,4a,5,6,7-hexahydrobenzo[c]pyranone](/api/spectrum/BmEICwOdAj6/structure.png?h=300&w=458 "(3S,4aR)-3-iso-Butyl-8-hydroxy-3,4,4a,5,6,7-hexahydrobenzo[c]pyranone")
| SpectraBase Compound ID | HmohT4bdpu7 |
|---|---|
| InChI | InChI=1S/C13H20O3/c1-8(2)6-10-7-9-4-3-5-11(14)12(9)13(15)16-10/h8-10,14H,3-7H2,1-2H3/t9-,10+/m1/s1 |
| InChIKey | POONGBAEDLHEGD-ZJUUUORDSA-N |
| Mol Weight | 224.3 g/mol |
| Molecular Formula | C13H20O3 |
| Exact Mass | 224.141245 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BmEICwOdAj6 |
|---|---|
| Name | (3S,4aR)-3-iso-Butyl-8-hydroxy-3,4,4a,5,6,7-hexahydrobenzo[c]pyranone |
| Alternate Name(s) | (3S,4aR)-8-hydroxy-3-isobutyl-3,4,4a,5,6,7-hexahydro-1H-2-benzopyran-1-one (3S,4aR)-8-hydroxy-3-(2-methylpropyl)-3,4,4a,5,6,7-hexahydro-2-benzopyran-1-one (3S,4aR)-8-hydroxy-3-(2-methylpropyl)-3,4,4a,5,6,7-hexahydroisochromen-1-one (3S,4aR)-3-(2-methylpropyl)-8-oxidanyl-3,4,4a,5,6,7-hexahydroisochromen-1-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H20O3 |
| InChI | InChI=1S/C13H20O3/c1-8(2)6-10-7-9-4-3-5-11(14)12(9)13(15)16-10/h8-10,14H,3-7H2,1-2H3/t9-,10+/m1/s1 |
| InChIKey | POONGBAEDLHEGD-ZJUUUORDSA-N |
| Molecular Weight | 224.300 g/mol |
| SMILES | OC1=C2C(O[C@](C[C@]2(CCC1)[H])(CC(C)C)[H])=O |
| SPLASH | splash10-00dl-8910000000-2a87d021be185c622052 |
| Source of Spectrum | SO-0-213-5 |
| Wiley ID | 873430 |